Vitas-M small molecule compound

5-methyl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Catalog ID
STK491970
SMILES CC1CCc2c(C1)cc(s2)C(=O)NCc1cccnc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H18N2OS MW 286.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2OS/c1-11-4-5-14-13(7-11)8-15(20-14)16(19)18-10-12-3-2-6-17-9-12/h2-3,6,8-9,11H,4-5,7,10H2,1H3,(H,18,19)
InChIKey
PKONQQIGWMXTTI-UHFFFAOYSA-N
Synonyms

5methylN(pyridin3ylmethyl)4567tetrahydro1benzothiophene2carboxamide
CC1CCC2=C(C1)C=C(S2)C(=O)NCC3=CN=CC=C3
InChI=1SC16H18N2OSc111451413(711)815(2014)16(19)18101232617912h2368911H45710H21H3(H1819)
MFCD06961716
ZINC000008710771
ZINC000008710772

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.